SCHEMBL15909767

SCHEMBL15909767

CC1(C)c2ccccc2-c2ccc(N(c3ccc(C#N)cc3)c3ccc(-c4cc5ccc6cc(-c7ccccc7)cc7ccc(c4)c5c67)cc3)cc21

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 3/20 0.41
PGR P06401 4/20 0.36
HRH3 Q9Y5N1 5/20 0.34
MYC P01106 1/20 0.33
ABCG2 Q9UNQ0 1/20 0.33
ALDH1A1 P00352 1/20 0.32
ATM Q13315 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
SCN9A Q15858 1/20 0.32
PTGDR2 Q9Y5Y4 1/20 0.32
LTB4R2 Q9NPC1 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL15909828 0.96 PDK2 (0.46) PDK2PGRHRH3MYCABCG2
SCHEMBL15909622 0.90 PDK2 (0.40) PDK2PGRHRH3
SCHEMBL15726478 0.88 PDK2 (0.33) PDK2
SCHEMBL17936234 0.88 PDK2 (0.42) PDK2PGRMYCABCG2ALDH1A1
SCHEMBL15909738 0.87 PGR (0.37) PDK2PGR
SCHEMBL15907718 0.87 PDK2 (0.39) PDK2PGRMYC
SCHEMBL15909800 0.86 CYP11B2 (0.48) PDK2ABCG2GABRA1GABRG2GABRB3
SCHEMBL13930414 0.86 PGR (0.45) PDK2PGRHRH3ALDH1A1LTB4R2
SCHEMBL24686800 0.86 PDK2 (0.41) PDK2PGRHRH3
SCHEMBL15909797 0.86 CYP11B2 (0.43) PDK2PGRMYCABCG2GABRA1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9997713-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-12 US disclosed
US-9997713-B2 Organic light-emitting device SAMSUNG DISPLAY CO., LTD. (KR) 2018-06-12 US disclosed
US-20140209875-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed
US-20140209875-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2014-07-31 US disclosed